Geometry & MOs

Info

ID:	413454
PubChem CID:	135086403
Reduced:	NPO6C13H18 (1)
Stoich.:	ABC6D13E18 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-283.84
Dipole, Da:	5.0
IP(EA), eV:	-9.34(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-dimethylphenyl)-N-methoxy-N-methyl-4-oxobutanamide

Drug info:

PubChemData

Smile

CC(=O)NC(C(=O)C1=CC=C(C=C1)OC)P(=O)(OC)OC

DOS

IR

Vibrations