Geometry & MOs

Info

ID:	383481
PubChem CID:	134975224
Reduced:	O2N3C7H14 (2)
Stoich.:	A2B3C7D14 (2)
Weight, g/mol:	350.05176
ΔH_f, kcal/mol:	-31.75
Dipole, Da:	4.82
IP(EA), eV:	-9.22(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-1,4-dimethoxynaphthalen-2-yl)pent-4-en-2-ol

Drug info:

PubChemData

Smile

C/C(=N\O)/CN(C/C(=N\O)/C)CCN(C/C(=N\O)/C)C/C(=N/O)/C

DOS

IR

Vibrations