Geometry & MOs

Info

ID:	402154
PubChem CID:	135054674
Reduced:	NO3C23H27 (1)
Stoich.:	AB3C23D27 (1)
Weight, g/mol:	407.105499
ΔH_f, kcal/mol:	-47.19
Dipole, Da:	4.8
IP(EA), eV:	-8.16(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-benzamido-3-(2,4-dichlorophenyl)-2-methylpropanoate

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C#C[C@H](C(=O)OC)NC2=CC=C(C=C2)OC

DOS

IR

Vibrations