Geometry & MOs

Info

ID:	266017
PubChem CID:	103557618
Reduced:	BrO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	300.128093
ΔH_f, kcal/mol:	-123.17
Dipole, Da:	1.95
IP(EA), eV:	-8.96(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-chloro-2-(1-methoxycyclobutyl)ethyl]-4-phenylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)C(CC2(CCC2)OC)O)C)Br

DOS

IR

Vibrations