Geometry & MOs

Info

ID:	54694
PubChem CID:	17389113
Reduced:	O2S3N4C12H16 (1)
Stoich.:	A2B3C4D12E16 (1)
Weight, g/mol:	212.061949
ΔH_f, kcal/mol:	1.37
Dipole, Da:	5.22
IP(EA), eV:	-8.17(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[(E)-(2-methylthiophen-3-yl)methylideneamino]carbamate

Drug info:

PubChemData

Smile

CC(=O)N/N=C/C1=C(SC(=C1/C=N/NC(=O)C)SC)SC

DOS

IR

Vibrations