Geometry & MOs

Info

ID:	4754
PubChem CID:	11971
Reduced:	SN2C8H10 (1)
Stoich.:	AB2C8D10 (1)
Weight, g/mol:	166.05647
ΔH_f, kcal/mol:	31.71
Dipole, Da:	2.51
IP(EA), eV:	-8.88(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methylphenyl)carbamimidothioic acid

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N=C(N)S

DOS

IR

Vibrations