Geometry & MOs

Info

ID:	394329
PubChem CID:	135022775
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	292.168797
ΔH_f, kcal/mol:	-11.88
Dipole, Da:	6.87
IP(EA), eV:	-8.87(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-benzyltriazol-4-yl)methyl]-2-phenylethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1OC)C(C)NCCCN2C=CN=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations