Geometry & MOs

Info

ID:	249972
PubChem CID:	103093218
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	305.100499
ΔH_f, kcal/mol:	-65.33
Dipole, Da:	2.7
IP(EA), eV:	-8.54(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[5-(3-chlorophenyl)thiophen-2-yl]-N-ethyl-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C(=C/C1=C(C(=CC=C1)OCC)OC)/C

DOS

IR

Vibrations