Geometry & MOs

Info

ID:	199999
PubChem CID:	79329786
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	291.111542
ΔH_f, kcal/mol:	-45.27
Dipole, Da:	1.41
IP(EA), eV:	-8.46(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propyl-2-[(4-thiophen-2-ylthiophen-2-yl)methylidene]butan-1-amine

Drug info:

PubChemData

Smile

CCC(=CC1=CC=C(C=C1)OC(C)C)CNC(C)C

DOS

IR

Vibrations