Geometry & MOs

Info

ID:	297049
PubChem CID:	117607107
Reduced:	O2N3C18H19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	249.93962
ΔH_f, kcal/mol:	-25.57
Dipole, Da:	5.44
IP(EA), eV:	-9.13(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-4-chloro-2-methoxyphenyl)methanol

Drug info:

PubChemData

Smile

C=CC(=O)N1CCC(CC1)C(=O)NC2=CC=NC3=CC=CC=C32

DOS

IR

Vibrations