Geometry & MOs

Info

ID:	222128
PubChem CID:	85294561
Reduced:	N4O12C43H52 (1)
Stoich.:	A4B12C43D52 (1)
Weight, g/mol:	818.073165
ΔH_f, kcal/mol:	-479.79
Dipole, Da:	5.01
IP(EA), eV:	-9.22(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(CC1=C2C(=CC=C1)OC(=N2)CCC(C(=O)OC)NC(=O)C(CC(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C)NC(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations