Geometry & MOs

Info

ID:	323711
PubChem CID:	126675786
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	352.189926
ΔH_f, kcal/mol:	-182.27
Dipole, Da:	1.79
IP(EA), eV:	-9.77(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C[C@@H](CC1=O)C2=CC=CC(=C2)CO

DOS

IR

Vibrations