Geometry & MOs

Info

ID:	62147
PubChem CID:	26717762
Reduced:	SN2O4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	485.05863
ΔH_f, kcal/mol:	-140.73
Dipole, Da:	6.09
IP(EA), eV:	-9.28(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[3-oxo-3-[2-[5-(phenoxymethyl)furan-2-carbonyl]hydrazinyl]propyl]benzamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations