Geometry & MOs

Info

ID:	172492
PubChem CID:	75516234
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	323.124547
ΔH_f, kcal/mol:	-88.86
Dipole, Da:	4.48
IP(EA), eV:	-8.76(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-phenyl-2-[[3-(trifluoromethyl)pyridin-2-yl]methylamino]propanamide

Drug info:

PubChemData

Smile

CC1CC(CC(O1)C)NCC2=C(N=CC=C2)N3CCC(CC3)C(=O)N

DOS

IR

Vibrations