Geometry & MOs

Info

ID:	150011
PubChem CID:	53789695
Reduced:	O7H10C14 (1)
Stoich.:	A7B10C14 (1)
Weight, g/mol:	412.272593
ΔH_f, kcal/mol:	-238.34
Dipole, Da:	5.35
IP(EA), eV:	-8.92(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-3-enyl N-[3-(1-pentan-3-ylpiperidin-4-yl)-1-benzofuran-5-yl]carbamate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1O)C(=O)OC(=O)C2=C(C=CC(=C2)O)O)O

DOS

IR

Vibrations