Geometry & MOs

Info

ID:	348891
PubChem CID:	127274616
Reduced:	ON3C9H14 (2)
Stoich.:	AB3C9D14 (2)
Weight, g/mol:	371.257277
ΔH_f, kcal/mol:	-5.67
Dipole, Da:	2.08
IP(EA), eV:	-8.53(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-4-phenylbutan-2-yl)-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CN2CCN(CC2)C(C)C(=O)NC3=C(N(N=C3C)C)C

DOS

IR

Vibrations