Geometry & MOs

Info

ID:	355654
PubChem CID:	127289412
Reduced:	OSN8C17H26 (1)
Stoich.:	ABC8D17E26 (1)
Weight, g/mol:	362.163729
ΔH_f, kcal/mol:	55.17
Dipole, Da:	4.25
IP(EA), eV:	-9.12(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)CSC3=NN=NN3C4CCCC4

DOS

IR

Vibrations