Geometry & MOs

Info

ID:	151988
PubChem CID:	56310824
Reduced:	SN3O3C23H29 (1)
Stoich.:	AB3C3D23E29 (1)
Weight, g/mol:	396.150764
ΔH_f, kcal/mol:	-88.0
Dipole, Da:	4.5
IP(EA), eV:	-8.51(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]naphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1CN(CCN1C(C)C(=O)NC2=CC=CC=C2SC)C3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations