Geometry & MOs

Info

ID:	195035
PubChem CID:	78625258
Reduced:	NSO6C17H23 (1)
Stoich.:	ABC6D17E23 (1)
Weight, g/mol:	370.01643
ΔH_f, kcal/mol:	-255.73
Dipole, Da:	4.0
IP(EA), eV:	-8.98(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(4-bromobenzoyl)hydrazinyl]-2-oxoethyl] oxolane-2-carboxylate

Drug info:

PubChemData

Smile

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C2CCCO2)C

DOS

IR

Vibrations