Geometry & MOs

Info

ID:	280566
PubChem CID:	103849912
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	415.178358
ΔH_f, kcal/mol:	-149.44
Dipole, Da:	5.32
IP(EA), eV:	-9.45(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(C)(C(=O)O)NC(=O)OCC2=CC=CC=C2)C

DOS

IR

Vibrations