Geometry & MOs

Info

ID:	30503
PubChem CID:	841422
Reduced:	NOC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	341.162708
ΔH_f, kcal/mol:	-32.97
Dipole, Da:	4.81
IP(EA), eV:	-9.13(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[[(2R)-2-(3-methylphenoxy)propanoyl]amino]benzoate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)[C@H](C)NC(=O)C2=CC(=C(C=C2)C)C

DOS

IR

Vibrations