Geometry & MOs

Info

ID:	449577
PubChem CID:	135299764
Reduced:	N2H40C55 (1)
Stoich.:	A2B40C55 (1)
Weight, g/mol:	288.147393
ΔH_f, kcal/mol:	215.85
Dipole, Da:	2.48
IP(EA), eV:	-7.77(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2,5-dioxo-3-propan-2-ylpyrrolidin-1-yl)phenyl]propanamide

Drug info:

PubChemData

Smile

CC1(C2=C(C=CC(=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C76)C8=CC=CC=C8)C9=C1C=C(C1=CC=CC=C19)C1=CC=CC=C1)C

DOS

IR

Vibrations