Geometry & MOs

Info

ID:	416106
PubChem CID:	135089114
Reduced:	ClON4C18H25 (1)
Stoich.:	ABC4D18E25 (1)
Weight, g/mol:	373.247775
ΔH_f, kcal/mol:	-19.1
Dipole, Da:	1.73
IP(EA), eV:	-8.87(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[1-(cyclohexylcarbamoyl)piperidin-4-yl]amino]-N,N-dimethylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)C(=O)C(C)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations