Geometry & MOs

Info

ID:	415519
PubChem CID:	135088515
Reduced:	O3N4C13H22 (1)
Stoich.:	A3B4C13D22 (1)
Weight, g/mol:	351.22704
ΔH_f, kcal/mol:	-132.06
Dipole, Da:	2.5
IP(EA), eV:	-9.47(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC(C(=O)N(CCO)CC1=NC=CN1)NC(=O)C

DOS

IR

Vibrations