Geometry & MOs

Info

ID:	213404
PubChem CID:	81063615
Reduced:	N2O4C15H24 (1)
Stoich.:	A2B4C15D24 (1)
Weight, g/mol:	277.131408
ΔH_f, kcal/mol:	-206.3
Dipole, Da:	2.53
IP(EA), eV:	-9.39(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)C1CC(=O)N(C1)C2CCCC2

DOS

IR

Vibrations