Geometry & MOs

Info

ID:	283624
PubChem CID:	103994110
Reduced:	NOC6H10 (2)
Stoich.:	ABC6D10 (2)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-91.94
Dipole, Da:	4.94
IP(EA), eV:	-9.25(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-2-(2-phenylpropylcarbamoylamino)butanoic acid

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN1CCC(CC1)(C)C#N

DOS

IR

Vibrations