Geometry & MOs

Info

ID:	198423
PubChem CID:	79100109
Reduced:	SN2O3C10H16 (1)
Stoich.:	AB2C3D10E16 (1)
Weight, g/mol:	242.141913
ΔH_f, kcal/mol:	-104.25
Dipole, Da:	1.91
IP(EA), eV:	-8.62(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2,5-dimethylpyrrol-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(N1NC2CS(=O)(=O)CC2O)C

DOS

IR

Vibrations