Geometry & MOs

Info

ID:	310256
PubChem CID:	126577434
Reduced:	SO2N6C22H26 (1)
Stoich.:	AB2C6D22E26 (1)
Weight, g/mol:	151.099714
ΔH_f, kcal/mol:	-2.76
Dipole, Da:	8.61
IP(EA), eV:	-9.12(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyl-2-propan-2-yl-1,3-oxazole

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)N)C3=NC=C(C(=N3)C4=CC(=NC=C4)C)N

DOS

IR

Vibrations