Geometry & MOs

Info

ID:	233760
PubChem CID:	92093364
Reduced:	BrN2O3H19C20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	386.163043
ΔH_f, kcal/mol:	-41.04
Dipole, Da:	4.21
IP(EA), eV:	-8.96(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(furan-2-yl)pyridin-3-yl]methyl]-3-(2-methoxynaphthalen-1-yl)propanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC(=O)NCC2=CN=C(C=C2)C3=CC=CO3)Br

DOS

IR

Vibrations