Geometry & MOs

Info

ID:	404626
PubChem CID:	135067977
Reduced:	FN2H19C20 (1)
Stoich.:	AB2C19D20 (1)
Weight, g/mol:	263.115758
ΔH_f, kcal/mol:	35.26
Dipole, Da:	4.69
IP(EA), eV:	-8.44(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6,8-dimethoxy-2,5-dihydro-1-benzazepine-1-carboxylate

Drug info:

PubChemData

Smile

C=C[C@H]1CN(CC2=C1C3=C(N2)C=CC(=C3)F)CC4=CC=CC=C4

DOS

IR

Vibrations