Geometry & MOs

Info

ID:	126267
PubChem CID:	50957983
Reduced:	ON2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	357.191323
ΔH_f, kcal/mol:	-55.88
Dipole, Da:	4.31
IP(EA), eV:	-8.35(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(5-aminotetrazol-1-yl)acetyl]amino]-N-cyclohexyl-2-methylbenzamide

Drug info:

PubChemData

Smile

CCCCC(=O)NC1=C(C=C(C=C1)NC(=O)C2=NC=CN2)C

DOS

IR

Vibrations