Geometry & MOs

Info

ID:	182910
PubChem CID:	76954212
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	297.132471
ΔH_f, kcal/mol:	-115.06
Dipole, Da:	5.21
IP(EA), eV:	-9.18(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-(2,6-dioxo-1,3-diazinan-4-yl)acetyl]piperidin-3-yl]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C=CC(=O)N2CCCC(C2)CC(=O)O

DOS

IR

Vibrations