Geometry & MOs

Info

ID:	270612
PubChem CID:	103637312
Reduced:	BrNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	-48.76
Dipole, Da:	4.57
IP(EA), eV:	-8.76(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-[[(2-methylcyclopropyl)methylamino]methyl]phenol

Drug info:

PubChemData

Smile

CC1CCCC(C1)NCC2=C(C=CC(=C2)Br)O

DOS

IR

Vibrations