Geometry & MOs

Info

ID:	170645
PubChem CID:	75263025
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	-59.05
Dipole, Da:	7.41
IP(EA), eV:	-8.98(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopent-2-en-1-yl-N-[3-(4-methyl-6-oxo-1,3-diazinan-2-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1CC(=O)NC(N1)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)C

DOS

IR

Vibrations