Geometry & MOs

Info

ID:	10238
PubChem CID:	99225
Reduced:	SN2C9H12 (1)
Stoich.:	AB2C9D12 (1)
Weight, g/mol:	180.07212
ΔH_f, kcal/mol:	22.77
Dipole, Da:	2.15
IP(EA), eV:	-8.82(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2,6-dimethylphenyl)carbamimidothioic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)N=C(N)S

DOS

IR

Vibrations