Geometry & MOs

Info

ID:	359089
PubChem CID:	127297334
Reduced:	ON2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	391.192963
ΔH_f, kcal/mol:	-49.39
Dipole, Da:	4.73
IP(EA), eV:	-8.3(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CCN(CC1)C2CCCC=C2

DOS

IR

Vibrations