Geometry & MOs

Info

ID:	173082
PubChem CID:	75593934
Reduced:	ON6C18H30 (1)
Stoich.:	AB6C18D30 (1)
Weight, g/mol:	352.168145
ΔH_f, kcal/mol:	-18.68
Dipole, Da:	5.92
IP(EA), eV:	-9.01(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[2-(1-methyltetrazol-5-yl)sulfanylethyl]-2-N-prop-2-enylcyclohexane-1,2-dicarboxamide

Drug info:

PubChemData

Smile

CCCN1C=NN=C1CNC(=O)C23CNCC2CN(C3)C4CCCC4

DOS

IR

Vibrations