Geometry & MOs

Info

ID:	325205
PubChem CID:	126681951
Reduced:	OC4H8 (5)
Stoich.:	AB4C8 (5)
Weight, g/mol:	321.21627
ΔH_f, kcal/mol:	-311.29
Dipole, Da:	3.54
IP(EA), eV:	-10.19(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2,4-dimethyl-3-oxopentan-2-yl)amino]phenyl]methyl 2-(deuterioamino)-2-methylpropanoate

Drug info:

PubChemData

Smile

CCCCCCC(C(CCCCCCCC(=O)OC(CC)CO)O)O

DOS

IR

Vibrations