Geometry & MOs

Info

ID:	351392
PubChem CID:	127280280
Reduced:	ON6C20H30 (1)
Stoich.:	AB6C20D30 (1)
Weight, g/mol:	385.149384
ΔH_f, kcal/mol:	8.71
Dipole, Da:	3.92
IP(EA), eV:	-8.78(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2C(=C(C(=N2)C)CC(=O)N(C)CCN3CCCC3)C)C

DOS

IR

Vibrations