Geometry & MOs

Info

ID:	399580
PubChem CID:	135041080
Reduced:	NOC16H23 (1)
Stoich.:	ABC16D23 (1)
Weight, g/mol:	180.151415
ΔH_f, kcal/mol:	-40.63
Dipole, Da:	4.94
IP(EA), eV:	-9.25(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-2-methyl-2-(4-methylpent-3-enyl)-3-prop-2-enyloxirane

Drug info:

PubChemData

Smile

CCC(=O)N(CC=C(C)C)[C@@H](C)C1=CC=CC=C1

DOS

IR

Vibrations