Geometry & MOs

Info

ID:	12951
PubChem CID:	219073
Reduced:	SH3N3O3C4 (1)
Stoich.:	AB3C3D3E4 (1)
Weight, g/mol:	172.989512
ΔH_f, kcal/mol:	-5.3
Dipole, Da:	3.19
IP(EA), eV:	-10.11(-2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-nitro-1,3-thiazol-2-yl)formamide

Drug info:

PubChemData

Smile

C1=C(SC(=N1)NC=O)[N+](=O)[O-]

DOS

IR

Vibrations