Geometry & MOs

Info

ID:	155795
PubChem CID:	56367575
Reduced:	NSO4C20H21 (1)
Stoich.:	ABC4D20E21 (1)
Weight, g/mol:	445.120861
ΔH_f, kcal/mol:	-98.8
Dipole, Da:	1.95
IP(EA), eV:	-8.4(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(6-phenylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC2=C(C=C1SC3=CC=CC=C3)OCCO2)OCC=C

DOS

IR

Vibrations