Geometry & MOs

Info

ID:	418375
PubChem CID:	135104394
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	386.151158
ΔH_f, kcal/mol:	1.98
Dipole, Da:	2.18
IP(EA), eV:	-9.11(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-4-ethoxy-3-methoxybenzamide

Drug info:

PubChemData

Smile

CC(C)C1=NC=CC(=N1)CN(C)CC2=CC(=CC=C2)O

DOS

IR

Vibrations