Geometry & MOs

Info

ID:	73995
PubChem CID:	48421325
Reduced:	O2N8C17H22 (1)
Stoich.:	A2B8C17D22 (1)
Weight, g/mol:	356.170922
ΔH_f, kcal/mol:	7.79
Dipole, Da:	16.46
IP(EA), eV:	-8.9(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-oxoimidazolidin-1-yl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2C=NN=N2)NC(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations