Geometry & MOs

Info

ID:	74702
PubChem CID:	48422316
Reduced:	BrN3O3C13H18 (1)
Stoich.:	AB3C3D13E18 (1)
Weight, g/mol:	345.132471
ΔH_f, kcal/mol:	-69.31
Dipole, Da:	3.01
IP(EA), eV:	-9.3(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[2-(2-methylfuran-3-carbonyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NNC(=O)C1=CC(=CN1C)Br)OCC2CC2

DOS

IR

Vibrations