Geometry & MOs

Info

ID:	195208
PubChem CID:	78655508
Reduced:	NO4C22H25 (1)
Stoich.:	AB4C22D25 (1)
Weight, g/mol:	381.157623
ΔH_f, kcal/mol:	-153.43
Dipole, Da:	5.76
IP(EA), eV:	-9.03(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-acetylanilino)-1-oxopropan-2-yl] 4-(4-methylphenyl)-4-oxobutanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC2=C(C=CC=C2C)C

DOS

IR

Vibrations