Geometry & MOs

Info

ID:	280477
PubChem CID:	103849481
Reduced:	NO5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	-189.21
Dipole, Da:	6.59
IP(EA), eV:	-9.2(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-hydroxyoxolan-3-yl)methyl]-1-phenyltriazole-4-carboxamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)C(=O)NCC3(CCOC3)O)OC1

DOS

IR

Vibrations