Geometry & MOs

Info

ID:	148438
PubChem CID:	53788100
Reduced:	N3O3H17C18 (1)
Stoich.:	A3B3C17D18 (1)
Weight, g/mol:	305.875353
ΔH_f, kcal/mol:	0.06
Dipole, Da:	7.07
IP(EA), eV:	-9.14(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,3,4,5,6-pentachlorophenyl)methyl]oxirane

Drug info:

PubChemData

Smile

CCOC1=C([N+](=CC=C1)[O-])C2=NC(OC3=C2C=C(C=C3)C#N)(C)C

DOS

IR

Vibrations