Geometry & MOs

Info

ID:	338380
PubChem CID:	127259072
Reduced:	NO3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	301.088498
ΔH_f, kcal/mol:	-84.85
Dipole, Da:	3.31
IP(EA), eV:	-8.27(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-C-(2-aminophenyl)sulfanyl-N-anilinocarbonimidoyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OCCOC1C2=CC=CC=C2C3=C1C=C(C=C3)N

DOS

IR

Vibrations