Geometry & MOs

Info

ID:	65977
PubChem CID:	46484795
Reduced:	O2N3H23C24 (1)
Stoich.:	A2B3C23D24 (1)
Weight, g/mol:	377.171497
ΔH_f, kcal/mol:	0.4
Dipole, Da:	6.57
IP(EA), eV:	-8.35(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylphenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CN2C=C(N=C2C=C1)COC3=CC=CC=C3C(=O)NC4=CC=CC(=C4C)C

DOS

IR

Vibrations