Geometry & MOs

Info

ID:	285268
PubChem CID:	104098911
Reduced:	SN4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	226.062139
ΔH_f, kcal/mol:	78.03
Dipole, Da:	5.23
IP(EA), eV:	-9.22(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorofuran-2-yl)methyl]-2-(triazol-1-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=CC=C(S1)CNCCN2C=CN=N2

DOS

IR

Vibrations