Geometry & MOs

Info

ID:	327924
PubChem CID:	126691385
Reduced:	OC15H22 (1)
Stoich.:	AB15C22 (1)
Weight, g/mol:	415.212058
ΔH_f, kcal/mol:	-38.77
Dipole, Da:	1.95
IP(EA), eV:	-8.48(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,4R)-2-methyloxan-4-yl]-2-[(4-propan-2-yltriazol-1-yl)methyl]imidazo[4,5-c]quinoline-8-carbonitrile

Drug info:

PubChemData

Smile

CC=CC1=CC=CC(=C1OC)CC(C)(C)C

DOS

IR

Vibrations