Geometry & MOs

Info

ID:	438716
PubChem CID:	135228467
Reduced:	OSN5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	337.120861
ΔH_f, kcal/mol:	33.68
Dipole, Da:	7.4
IP(EA), eV:	-9.0(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-3-ethylsulfonyl-4-methyl-N-(1-methyltetrazol-5-yl)benzamide

Drug info:

PubChemData

Smile

CCC1=C(C(=C(C=C1)C(=O)NC2=NN=NN2C)CC)SCC

DOS

IR

Vibrations