Geometry & MOs

Info

ID:	441879
PubChem CID:	135246321
Reduced:	N3C6H13 (1)
Stoich.:	A3B6C13 (1)
Weight, g/mol:	328.193949
ΔH_f, kcal/mol:	29.58
Dipole, Da:	2.08
IP(EA), eV:	-8.62(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-(2-ethylphenyl)pyridin-2-yl]methyl]-5,6,7,8-tetrahydroquinoline

Drug info:

PubChemData

Smile

CC(C)N1C=NCN1C

DOS

IR

Vibrations