Geometry & MOs

Info

ID:	208782
PubChem CID:	80585145
Reduced:	SN4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	245.119798
ΔH_f, kcal/mol:	37.72
Dipole, Da:	1.82
IP(EA), eV:	-7.93(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-hydroxyimino-2,2-dimethyl-N-(thiolan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

C1CC(SC1)CNC2=NC3=C(N2)C=C(C=C3)N

DOS

IR

Vibrations