Geometry & MOs

Info

ID:	5674
PubChem CID:	13475
Reduced:	NSC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	297.155121
ΔH_f, kcal/mol:	54.03
Dipole, Da:	1.85
IP(EA), eV:	-8.52(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-4-(3-methylsulfanylphenyl)-4-phenylbut-3-en-1-amine

Drug info:

PubChemData

Smile

CN(C)CCC=C(C1=CC=CC=C1)C2=CC(=CC=C2)SC

DOS

IR

Vibrations