Geometry & MOs

Info

ID:	252515
PubChem CID:	103111900
Reduced:	N4O4C13H22 (1)
Stoich.:	A4B4C13D22 (1)
Weight, g/mol:	297.168856
ΔH_f, kcal/mol:	-129.53
Dipole, Da:	8.91
IP(EA), eV:	-9.75(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethyl 1-(3-methoxycyclohexyl)-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(N=NN1CC(=O)N(C)C(C)C)C(=O)OCCOC

DOS

IR

Vibrations