Geometry & MOs

Info

ID:	408053
PubChem CID:	135080808
Reduced:	N8O9C118H136 (1)
Stoich.:	A8B9C118D136 (1)
Weight, g/mol:	1014.93899
ΔH_f, kcal/mol:	106.95
Dipole, Da:	12.64
IP(EA), eV:	-8.14(-3.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC2=CC3=C4NC(=C3C=C2OC5=CC=C(C=C5)C(C)(C)CC(C)(C)C)N=C6C7=CC(=C(C=C7C(=N6)N=C8C9=CC1=C(C=C9C(=NC2=NC(=N4)C3=CC(=C(C=C32)OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)N8)C(=O)OC1=O)OC1=CC=C(C=C1)C(C)(C)CC(C)(C)C)OC1=CC=C(C=C1)C(C)(C)CC(C)(C)C

DOS

IR

Vibrations