Geometry & MOs

Info

ID:	343816
PubChem CID:	127266992
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	275.17461
ΔH_f, kcal/mol:	-8.97
Dipole, Da:	3.61
IP(EA), eV:	-8.04(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-methoxy-3,5-dimethylpyridin-2-yl)methyl]-1-(1-methyl-1,2,4-triazol-3-yl)ethanamine

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)NC2=CC=C(C=C2)NCC3=NOC=C3

DOS

IR

Vibrations