Geometry & MOs

Info

ID:	76918
PubChem CID:	48425572
Reduced:	NOC4H7 (3)
Stoich.:	ABC4D7 (3)
Weight, g/mol:	267.169525
ΔH_f, kcal/mol:	-154.45
Dipole, Da:	5.89
IP(EA), eV:	-9.68(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-4-(1,2,4-triazol-1-yl)butanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1CCC(=O)NC1

DOS

IR

Vibrations