Geometry & MOs

Info

ID:	252685
PubChem CID:	103113235
Reduced:	SN2O3C14H18 (1)
Stoich.:	AB2C3D14E18 (1)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	-76.11
Dipole, Da:	2.89
IP(EA), eV:	-9.51(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C1=CSC(=C1)C#CCO

DOS

IR

Vibrations