Geometry & MOs

Info

ID:	255685
PubChem CID:	103134002
Reduced:	NOH15C18 (1)
Stoich.:	ABC15D18 (1)
Weight, g/mol:	275.094629
ΔH_f, kcal/mol:	28.57
Dipole, Da:	6.04
IP(EA), eV:	-9.4(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dihydro-2-benzofuran-5-yl(isoquinolin-8-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)C2=CC=CC3=C2C=NC=C3)C

DOS

IR

Vibrations