Geometry & MOs

Info

ID:	259204
PubChem CID:	103158592
Reduced:	O3C17H22 (1)
Stoich.:	A3B17C22 (1)
Weight, g/mol:	275.148121
ΔH_f, kcal/mol:	-123.97
Dipole, Da:	3.78
IP(EA), eV:	-9.15(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[2-(dimethylamino)-2-oxoethyl]-methylcarbamoyl]amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

C1CCC(C1)CC(COC2=CC=CC3=C2CCC3=O)O

DOS

IR

Vibrations