Geometry & MOs

Info

ID:	265711
PubChem CID:	103541266
Reduced:	ClNSO4C14H20 (1)
Stoich.:	ABCD4E14F20 (1)
Weight, g/mol:	336.091056
ΔH_f, kcal/mol:	-156.63
Dipole, Da:	4.68
IP(EA), eV:	-9.48(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-4-(3,4-dimethoxypyrrolidin-1-yl)sulfonyl-1-ethylpyrrole

Drug info:

PubChemData

Smile

COC1CN(CC1OC)S(=O)(=O)CC2=CC=C(C=C2)CCl

DOS

IR

Vibrations