Geometry & MOs

Info

ID:	327842
PubChem CID:	126691147
Reduced:	NOH11C15 (1)
Stoich.:	ABC11D15 (1)
Weight, g/mol:	372.169859
ΔH_f, kcal/mol:	35.86
Dipole, Da:	3.66
IP(EA), eV:	-8.65(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,4R)-2-methyloxan-4-yl]-2-(pyrazol-1-ylmethyl)imidazo[4,5-c]quinoline-8-carbonitrile

Drug info:

PubChemData

Smile

C=C1C2=CC=CC=C2C(=O)C3=CC=CC=C3N1

DOS

IR

Vibrations