Geometry & MOs

Info

ID:	246040
PubChem CID:	103036888
Reduced:	BrNOC14H22 (1)
Stoich.:	ABCD14E22 (1)
Weight, g/mol:	295.170292
ΔH_f, kcal/mol:	-45.93
Dipole, Da:	5.57
IP(EA), eV:	-9.18(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)-5-methoxy-5-methylhexyl]cyclopropanamine

Drug info:

PubChemData

Smile

CC(C)(CCC(CN)C1=CC=C(C=C1)Br)OC

DOS

IR

Vibrations