Geometry & MOs

Info

ID:	443827
PubChem CID:	135260112
Reduced:	O2C19H26 (1)
Stoich.:	A2B19C26 (1)
Weight, g/mol:	316.14633
ΔH_f, kcal/mol:	-82.64
Dipole, Da:	5.78
IP(EA), eV:	-9.38(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-4-(4-methoxyphenyl)but-2-en-2-yl]naphthalene-1-carbaldehyde

Drug info:

PubChemData

Smile

CC1C(C(C2=C(C1(C)C)C=C(C(=C2C=O)C=O)C)(C)C)C

DOS

IR

Vibrations