Geometry & MOs

Info

ID:	64558
PubChem CID:	29202859
Reduced:	N4O4C25H30 (1)
Stoich.:	A4B4C25D30 (1)
Weight, g/mol:	340.142307
ΔH_f, kcal/mol:	-118.77
Dipole, Da:	1.79
IP(EA), eV:	-8.47(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 4-(carbamoylamino)benzoate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=O)[C@@H](N(C3=O)C4=CC=C(C=C4)C)C

DOS

IR

Vibrations