Geometry & MOs

Info

ID:	152993
PubChem CID:	56312100
Reduced:	SN2O5C21H26 (1)
Stoich.:	AB2C5D21E26 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-156.6
Dipole, Da:	3.74
IP(EA), eV:	-7.88(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methylsulfamoyl]-3-methylbenzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2CCN(C2)C3=CC=CC=C3OC

DOS

IR

Vibrations