Geometry & MOs

Info

ID:	430419
PubChem CID:	135170483
Reduced:	ON2C10H16 (1)
Stoich.:	AB2C10D16 (1)
Weight, g/mol:	192.126263
ΔH_f, kcal/mol:	11.55
Dipole, Da:	2.89
IP(EA), eV:	-9.72(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-(2-methylpentan-2-yl)-1,2-oxazole-4-carbonitrile

Drug info:

PubChemData

Smile

CCC(C)C1=C(C(=NO1)C)CN=C

DOS

IR

Vibrations