Geometry & MOs

Info

ID:	47987
PubChem CID:	10536184
Reduced:	N2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	-38.52
Dipole, Da:	7.52
IP(EA), eV:	-9.23(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,3S,4S)-4-methoxy-1-phenylhexa-1,5-dien-3-ol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C=C(O2)NCCN

DOS

IR

Vibrations