Geometry & MOs

Info

ID:	417524
PubChem CID:	135098518
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	380.126674
ΔH_f, kcal/mol:	-93.94
Dipole, Da:	2.05
IP(EA), eV:	-9.04(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-(2H-tetrazol-5-yl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1)C)CN2CC[C@]([C@H](C2)O)(CC3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations