Geometry & MOs

Info

ID:	168755
PubChem CID:	75014583
Reduced:	ClO12N15C76H98 (1)
Stoich.:	AB12C15D76E98 (1)
Weight, g/mol:	1623.801836
ΔH_f, kcal/mol:	-484.61
Dipole, Da:	3.16
IP(EA), eV:	-8.23(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

CC(C)CC(C(=O)NC(CCCCNC(C)C)C(=O)N1CCCC1C(=O)NCC(=O)N)N(C)C(=O)C(CC2=CC=C(C=C2)N)NC(=O)C(CC3=CC=C(C=C3)N)NC(=O)C(CO)NC(=O)C(CC4=CN=CC=C4)NC(=O)C(CC5=CC=C(C=C5)Cl)NC(=O)C(CC6=CC7=CC=CC=C7C=C6)NC(=O)C

DOS

IR

Vibrations