Geometry & MOs

Info

ID:	211506
PubChem CID:	81044170
Reduced:	ClON2C16H23 (1)
Stoich.:	ABC2D16E23 (1)
Weight, g/mol:	302.166414
ΔH_f, kcal/mol:	-62.72
Dipole, Da:	5.22
IP(EA), eV:	-8.79(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,1-dioxothiolan-3-yl)methyl]-3-piperidin-3-ylbutanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)NC(=O)CC(C)C2CCCNC2

DOS

IR

Vibrations