Geometry & MOs

Info

ID:	447469
PubChem CID:	135283109
Reduced:	O3N6C28H32 (1)
Stoich.:	A3B6C28D32 (1)
Weight, g/mol:	486.237939
ΔH_f, kcal/mol:	-18.94
Dipole, Da:	2.16
IP(EA), eV:	-8.39(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylprop-2-enoylamino)ethyl N-[[4-[(4-amino-2-ethylimidazo[4,5-c]quinolin-1-yl)methyl]phenyl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(=C)CNCCOC(=O)NCC1=CC=C(C=C1)CN2C(=NC3=C2C4=CC=CC=C4N=C3N)C5CCO5

DOS

IR

Vibrations