Geometry & MOs

Info

ID:	394744
PubChem CID:	135023672
Reduced:	NO5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	339.183444
ΔH_f, kcal/mol:	-160.93
Dipole, Da:	7.3
IP(EA), eV:	-9.84(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2R,3S)-2,4-dimethyl-1-oxo-1-phenylpentan-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)[C@H]1[C@](C(=O)OCN1C(=O)OCC2=CC=CC=C2)(C)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations