Geometry & MOs

Info

ID:	375575
PubChem CID:	134214001
Reduced:	INOC5H10 (1)
Stoich.:	ABCD5E10 (1)
Weight, g/mol:	425.111789
ΔH_f, kcal/mol:	-31.2
Dipole, Da:	2.23
IP(EA), eV:	-9.18(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-chloro-5-(2-hydroxyethyl)pyridin-2-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide

Drug info:

PubChemData

Smile

CNCCC(=O)CI

DOS

IR

Vibrations