Geometry & MOs

Info

ID:	217228
PubChem CID:	85087471
Reduced:	ClO4H17C19 (1)
Stoich.:	AB4C17D19 (1)
Weight, g/mol:	344.09277
ΔH_f, kcal/mol:	-3.84
Dipole, Da:	2.0
IP(EA), eV:	-9.38(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[2-(4-chlorophenyl)-3-phenylcyclopropyl]-N-nitrosocarbamate

Drug info:

PubChemData

Smile

CC1(OC2C3C=CC(C2O1)(C4C3C(=O)C5=CC=CC=C5C4=O)Cl)C

DOS

IR

Vibrations