Geometry & MOs

Info

ID:	126189
PubChem CID:	50954888
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	234.148061
ΔH_f, kcal/mol:	-8.62
Dipole, Da:	5.91
IP(EA), eV:	-8.64(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-1-(furan-2-yl)-2-(1,2,4-triazol-4-yl)ethanamine

Drug info:

PubChemData

Smile

CCN1C=CC(=N1)C(=O)N(CC2=CC(=CC=C2)OCC)C3CC3

DOS

IR

Vibrations