Geometry & MOs

Info

ID:	197460
PubChem CID:	78967151
Reduced:	ON3C9H17 (1)
Stoich.:	AB3C9D17 (1)
Weight, g/mol:	264.140868
ΔH_f, kcal/mol:	-7.14
Dipole, Da:	1.93
IP(EA), eV:	-9.05(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[cyclopropyl(3-methylbutyl)amino]pyrazine-2-carbothioamide

Drug info:

PubChemData

Smile

CN(C1CCOC1)C(=NC2CC2)N

DOS

IR

Vibrations