Geometry & MOs

Info

ID:	425658
PubChem CID:	135127209
Reduced:	N3C19H21 (1)
Stoich.:	A3B19C21 (1)
Weight, g/mol:	376.193949
ΔH_f, kcal/mol:	71.86
Dipole, Da:	3.44
IP(EA), eV:	-8.01(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,9,9-trimethyl-6-(4-methyl-5-phenylpyridin-2-yl)indeno[2,1-b]pyridine

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=C1)C3=C(C2(C)C)C=CC=N3)N4CN(C=C4)C

DOS

IR

Vibrations