Geometry & MOs

Info

ID:	342876
PubChem CID:	127266039
Reduced:	SO2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	339.161663
ΔH_f, kcal/mol:	-54.76
Dipole, Da:	4.95
IP(EA), eV:	-8.42(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,2-dimethylpyrrolidin-1-yl)ethyl]-3-(4-methylsulfonylphenyl)urea

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)N2CCC(S(=O)CC2)(C)C

DOS

IR

Vibrations