Geometry & MOs

Info

ID:

183161

PubChem CID:

76984549

Reduced:

SO2N4C13H19 (1)

Stoich.:

AB2C4D13E19 (1)

Weight, g/mol:

321.070261

ΔHf, kcal/mol:

-49.1

Dipole, Da:

3.14

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.755471

Charge, e:

 0

Chem-info

IUPAC name:

4-chloro-2-[cyclopropyl(thiophen-2-ylmethyl)amino]-N'-hydroxybenzenecarboximidamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C(C)NCC2C=[N+](C(=O)N(C2=O)C)C

DOS

IR

Vibrations