Geometry & MOs

Info

ID:	441287
PubChem CID:	135233978
Reduced:	SN4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	252.151415
ΔH_f, kcal/mol:	80.48
Dipole, Da:	6.42
IP(EA), eV:	-7.43(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-2-phenylprop-1-enyl]-4-propan-2-yloxybenzene

Drug info:

PubChemData

Smile

CC(=NCCC1=CC(=C)C=CN1C)C2=CSC(=N2)N

DOS

IR

Vibrations