Geometry & MOs

Info

ID:	285854
PubChem CID:	104134014
Reduced:	ClOSN2C16H19 (1)
Stoich.:	ABCD2E16F19 (1)
Weight, g/mol:	308.165541
ΔH_f, kcal/mol:	-12.57
Dipole, Da:	5.93
IP(EA), eV:	-9.22(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-methyl-N-(4-methylcyclohexyl)-6-propan-2-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)N(C)CC2=C(C=CS2)C)Cl

DOS

IR

Vibrations