Geometry & MOs

Info

ID:	198249
PubChem CID:	79074308
Reduced:	NOC14H29 (1)
Stoich.:	ABC14D29 (1)
Weight, g/mol:	337.10413
ΔH_f, kcal/mol:	-92.5
Dipole, Da:	3.15
IP(EA), eV:	-8.84(2.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-1-[1-(dimethylamino)cycloheptyl]ethanone

Drug info:

PubChemData

Smile

CCCCC(C1(CCCC(C1)C)N(C)C)O

DOS

IR

Vibrations