Geometry & MOs

Info

ID:	138091
PubChem CID:	52312213
Reduced:	N2O3C24H30 (1)
Stoich.:	A2B3C24D30 (1)
Weight, g/mol:	410.247738
ΔH_f, kcal/mol:	-110.1
Dipole, Da:	2.28
IP(EA), eV:	-8.63(0.1)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[[3-(cyclopropylmethylsulfamoyl)benzoyl]-(2-methylpropyl)amino]ethyl-diethylazanium

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N[C@@H](CN2CCCC2=O)C3=CC=CC=C3

DOS

IR

Vibrations