Geometry & MOs

Info

ID:	351166
PubChem CID:	127279724
Reduced:	SN2O3C17H24 (1)
Stoich.:	AB2C3D17E24 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-130.95
Dipole, Da:	2.05
IP(EA), eV:	-9.06(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]phenyl]methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1CCCN(C1)C(=O)C2=CC3=C(S2)CCOC3

DOS

IR

Vibrations