Geometry & MOs

Info

ID:	408421
PubChem CID:	135081187
Reduced:	BrOC10H11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	2.71
Dipole, Da:	2.71
IP(EA), eV:	-9.64(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-2-methylcyclopentan-1-one

Drug info:

PubChemData

Smile

CC[C@@]1(CO1)C2=CC=C(C=C2)Br

DOS

IR

Vibrations