Geometry & MOs

Info

ID:	298436
PubChem CID:	117649465
Reduced:	NO3C18H27 (1)
Stoich.:	AB3C18D27 (1)
Weight, g/mol:	367.214744
ΔH_f, kcal/mol:	-156.88
Dipole, Da:	1.06
IP(EA), eV:	-9.42(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1R,3R)-1,3-bis(4-methylphenyl)-2-oxobutyl]carbamate

Drug info:

PubChemData

Smile

CCCCC(=O)[C@@H](C1=CC=CC(=C1)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations