Geometry & MOs

Info

ID:	441190
PubChem CID:	135233515
Reduced:	ON6C28H40 (1)
Stoich.:	AB6C28D40 (1)
Weight, g/mol:	241.18305
ΔH_f, kcal/mol:	-24.15
Dipole, Da:	4.83
IP(EA), eV:	-8.2(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-(2-methylpropyl)-6-phenyl-2H-pyridine

Drug info:

PubChemData

Smile

CC1(CCC(CC1NC(=O)CC2=NC3=CC=CC=C3N2)C4=NC(=C(C=C4)NCC(C)(C)C)NC)C

DOS

IR

Vibrations