Geometry & MOs

Info

ID:	237169
PubChem CID:	92717738
Reduced:	FN4O4H17C19 (1)
Stoich.:	AB4C4D17E19 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	-85.69
Dipole, Da:	1.71
IP(EA), eV:	-8.45(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]triazole-4-carboxamide

Drug info:

PubChemData

Smile

C[C@H](COC1=CC2=C(C=C1)OCO2)NC(=O)C3=CN(N=N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations