Geometry & MOs

Info

ID:	74646
PubChem CID:	48422230
Reduced:	BrN2O4C16H21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	368.176979
ΔH_f, kcal/mol:	-114.42
Dipole, Da:	3.14
IP(EA), eV:	-9.3(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[3-(diethylsulfamoyl)-4-methylphenyl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NNC(=O)C(C)OC1=CC(=CC=C1)Br)OCC2CC2

DOS

IR

Vibrations