Geometry & MOs

Info

ID:	368347
PubChem CID:	127327942
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	395.232125
ΔH_f, kcal/mol:	-67.81
Dipole, Da:	11.56
IP(EA), eV:	-9.18(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-methylpiperidine-1-carbonyl)phenyl]-3-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=O)C=C(N1)C2=CC=C(C=C2)NC(=O)NC3(CCCCC3)C

DOS

IR

Vibrations