Geometry & MOs

Info

ID:	76378
PubChem CID:	48424851
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	401.175084
ΔH_f, kcal/mol:	-137.26
Dipole, Da:	2.96
IP(EA), eV:	-9.38(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[3-[(2-fluorobenzoyl)amino]propylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCC1CCCCO1)OCC2CC2

DOS

IR

Vibrations