Geometry & MOs

Info

ID:	61784
PubChem CID:	26713062
Reduced:	ClN2O4H23C24 (1)
Stoich.:	AB2C4D23E24 (1)
Weight, g/mol:	374.13972
ΔH_f, kcal/mol:	-106.97
Dipole, Da:	5.33
IP(EA), eV:	-8.96(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl]-4-propan-2-yloxybenzamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=CC(=CC=C3)OC

DOS

IR

Vibrations