Geometry & MOs

Info

ID:	207921
PubChem CID:	80471074
Reduced:	BrNC17H24 (1)
Stoich.:	ABC17D24 (1)
Weight, g/mol:	259.193614
ΔH_f, kcal/mol:	17.2
Dipole, Da:	2.65
IP(EA), eV:	-8.95(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-[(propan-2-ylamino)methyl]-3-bicyclo[3.1.0]hexanyl]methyl]phenol

Drug info:

PubChemData

Smile

CC(C)NCC1(CC2CC2C1)CC3=CC(=CC=C3)Br

DOS

IR

Vibrations