Geometry & MOs

Info

ID:	135143
PubChem CID:	51823690
Reduced:	N2O3C27H44 (1)
Stoich.:	A2B3C27D44 (1)
Weight, g/mol:	436.272593
ΔH_f, kcal/mol:	-184.71
Dipole, Da:	2.95
IP(EA), eV:	-9.33(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-N-[(2R,3R)-1-(cyclohexylamino)-1-oxo-3-phenylbutan-2-yl]-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(C)(C)NC(=O)[C@H](C1CCCCC1)N(C(=O)C2=CC=CC=C2O)C(C)(C)C

DOS

IR

Vibrations