Geometry & MOs

Info

ID:	194432
PubChem CID:	78535229
Reduced:	NO4C25H25 (1)
Stoich.:	AB4C25D25 (1)
Weight, g/mol:	410.092101
ΔH_f, kcal/mol:	-95.12
Dipole, Da:	3.77
IP(EA), eV:	-8.59(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(6-methoxynaphthalen-2-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN(C)C(=O)COC(=O)C=CC2=CC3=C(C=C2)C=C(C=C3)OC

DOS

IR

Vibrations