Geometry & MOs

Info

ID:	447449
PubChem CID:	135282965
Reduced:	ClON4C18H21 (1)
Stoich.:	ABC4D18E21 (1)
Weight, g/mol:	546.259068
ΔH_f, kcal/mol:	28.49
Dipole, Da:	7.14
IP(EA), eV:	-9.49(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C[C@@](C)(COC1=C(C=C(C=C1)C2=NC(=NC=C2)Cl)C#N)N

DOS

IR

Vibrations