Geometry & MOs

Info

ID:	55975
PubChem CID:	17398092
Reduced:	N2O2C21H24 (1)
Stoich.:	A2B2C21D24 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-34.37
Dipole, Da:	10.29
IP(EA), eV:	-8.5(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-(3-acetamidopropanoylamino)benzoate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)OC(=O)C=C2CN3CCCC3C4=CC=CN4C

DOS

IR

Vibrations