Geometry & MOs

Info

ID:	353592
PubChem CID:	127285169
Reduced:	SN3O3C18H29 (1)
Stoich.:	AB3C3D18E29 (1)
Weight, g/mol:	354.180424
ΔH_f, kcal/mol:	-157.73
Dipole, Da:	6.12
IP(EA), eV:	-9.05(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-[4-(tetrazol-1-yl)phenyl]acetyl]piperidin-4-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CSCC(=O)N2CCC(CC2)N3CCCC3=O

DOS

IR

Vibrations