Geometry & MOs

Info

ID:	5728
PubChem CID:	13559
Reduced:	S2N4C7H14 (1)
Stoich.:	A2B4C7D14 (1)
Weight, g/mol:	218.065989
ΔH_f, kcal/mol:	64.06
Dipole, Da:	2.0
IP(EA), eV:	-9.24(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(N-but-3-en-2-yl-C-sulfanylcarbonimidoyl)amino]-N'-methylcarbamimidothioic acid

Drug info:

PubChemData

Smile

CC(C=C)N=C(NNC(=NC)S)S

DOS

IR

Vibrations