Geometry & MOs

Info

ID:	285256
PubChem CID:	104098843
Reduced:	N5C15H23 (1)
Stoich.:	A5B15C23 (1)
Weight, g/mol:	268.113567
ΔH_f, kcal/mol:	69.48
Dipole, Da:	6.61
IP(EA), eV:	-8.15(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(difluoromethoxy)phenyl]methyl]-2-(triazol-1-yl)ethanamine

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)CNCCN2C=CN=N2

DOS

IR

Vibrations