Geometry & MOs

Info

ID:	76256
PubChem CID:	48424688
Reduced:	ClN2O3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	356.153621
ΔH_f, kcal/mol:	-103.11
Dipole, Da:	4.53
IP(EA), eV:	-9.53(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(5-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)Cl)OCC3CC3

DOS

IR

Vibrations