Geometry & MOs

Info

ID:	270891
PubChem CID:	103638585
Reduced:	SN2C15H18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	257.123821
ΔH_f, kcal/mol:	57.23
Dipole, Da:	2.11
IP(EA), eV:	-8.99(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[(5-ethylthiophen-2-yl)methyl]-3-phenylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCNC/C=C/C2=CC=CC=C2

DOS

IR

Vibrations