Geometry & MOs

Info

ID:	243271
PubChem CID:	99218133
Reduced:	SN2O3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	384.150764
ΔH_f, kcal/mol:	-94.19
Dipole, Da:	6.46
IP(EA), eV:	-9.11(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(1,3-dioxoisoindol-2-yl)-4-methyl-N-[(1R)-1-(5-methylthiophen-2-yl)ethyl]pentanamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)[C@H](C)NC(=O)[C@@H](CC(C)C)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations