Geometry & MOs

Info

ID:	220837
PubChem CID:	85240158
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	277.131408
ΔH_f, kcal/mol:	-153.68
Dipole, Da:	3.24
IP(EA), eV:	-9.14(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-5-(phenylmethoxycarbonylamino)hex-2-enoic acid

Drug info:

PubChemData

Smile

CCOC(=O)C=CC(=O)NC1=C(C=CC(=C1CO)C)C

DOS

IR

Vibrations