Geometry & MOs

Info

ID:	252533
PubChem CID:	103112071
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	257.137556
ΔH_f, kcal/mol:	-86.8
Dipole, Da:	4.68
IP(EA), eV:	-8.12(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethyl 1-(3-hydroxy-2-methylpropyl)-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CCNC1=CC=CC=C1C(=O)NC(C)C(=O)N(C)CC

DOS

IR

Vibrations