Geometry & MOs

Info

ID:	53350
PubChem CID:	14710576
Reduced:	BrNOC18H20 (1)
Stoich.:	ABCD18E20 (1)
Weight, g/mol:	197.120449
ΔH_f, kcal/mol:	15.68
Dipole, Da:	2.41
IP(EA), eV:	-9.39(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-naphthalen-1-ylbut-3-en-1-amine

Drug info:

PubChemData

Smile

C=CC[C@H](C1=CC=C(C=C1)Br)N[C@@H](CO)C2=CC=CC=C2

DOS

IR

Vibrations