Geometry & MOs

Info

ID:	250048
PubChem CID:	103093790
Reduced:	NOC14H23 (1)
Stoich.:	ABC14D23 (1)
Weight, g/mol:	237.155121
ΔH_f, kcal/mol:	-36.09
Dipole, Da:	0.96
IP(EA), eV:	-8.32(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(5-ethylthiophen-2-yl)-3-methyl-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C(=C/C1=CC=C(O1)CC)/C

DOS

IR

Vibrations