Geometry & MOs

Info

ID:	285735
PubChem CID:	104123281
Reduced:	ClON2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	308.165541
ΔH_f, kcal/mol:	-8.06
Dipole, Da:	4.97
IP(EA), eV:	-9.78(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)Cl)C(=O)N(C)CC=C

DOS

IR

Vibrations