Geometry & MOs

Info

ID:	364339
PubChem CID:	127315479
Reduced:	SN4O4C16H28 (1)
Stoich.:	AB4C4D16E28 (1)
Weight, g/mol:	350.206639
ΔH_f, kcal/mol:	-139.99
Dipole, Da:	4.03
IP(EA), eV:	-8.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-[4-[2-(tetrazol-1-yl)acetyl]piperazin-1-yl]butan-1-one

Drug info:

PubChemData

Smile

CCN1CCC(CC1)N(C)C(=O)[C@H](C)NS(=O)(=O)C2=C(ON=C2C)C

DOS

IR

Vibrations