Geometry & MOs

Info

ID:	340188
PubChem CID:	127262197
Reduced:	ClN2O2C14H21 (1)
Stoich.:	AB2C2D14E21 (1)
Weight, g/mol:	432.186064
ΔH_f, kcal/mol:	-110.8
Dipole, Da:	1.88
IP(EA), eV:	-9.1(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4S)-4-benzyl-7-(benzylamino)-6,6-difluoro-2-methyl-5,7-dioxoheptan-2-yl] carbamate

Drug info:

PubChemData

Smile

C1CCN(C1)CCNC(=O)OCC2=CC=CC=C2.Cl

DOS

IR

Vibrations