Geometry & MOs

Info

ID:	285283
PubChem CID:	104098933
Reduced:	N2C5H10 (2)
Stoich.:	A2B5C10 (2)
Weight, g/mol:	286.122989
ΔH_f, kcal/mol:	33.68
Dipole, Da:	4.56
IP(EA), eV:	-9.42(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-2-(triazol-1-yl)ethanamine

Drug info:

PubChemData

Smile

CCC(CC)CNCCN1C=CN=N1

DOS

IR

Vibrations