Geometry & MOs

Info

ID:	134648
PubChem CID:	51733968
Reduced:	Cl2O2N3C27H29 (1)
Stoich.:	A2B2C3D27E29 (1)
Weight, g/mol:	522.228535
ΔH_f, kcal/mol:	-47.57
Dipole, Da:	5.63
IP(EA), eV:	-8.35(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-hydroxy-N-[(1R)-1-(3-methoxyphenyl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)[C@@H](C1=CC=C(C=C1)N(C)C)N(C2=CC(=CC=C2)Cl)C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations