Geometry & MOs

Info

ID:	75010
PubChem CID:	48422854
Reduced:	NO3C19H27 (1)
Stoich.:	AB3C19D27 (1)
Weight, g/mol:	399.143035
ΔH_f, kcal/mol:	-101.18
Dipole, Da:	3.88
IP(EA), eV:	-9.16(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC(CC1)OCC2=CC=CC=C2)OCC3CC3

DOS

IR

Vibrations