Geometry & MOs

Info

ID:	415724
PubChem CID:	135088724
Reduced:	O2N5C19H27 (1)
Stoich.:	A2B5C19D27 (1)
Weight, g/mol:	340.145678
ΔH_f, kcal/mol:	-38.2
Dipole, Da:	8.87
IP(EA), eV:	-8.56(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C(N1)CN(CCO)C(=O)C2=CC=C(C=C2)N3CCN(CC3)C

DOS

IR

Vibrations