Geometry & MOs

Info

ID:	54212
PubChem CID:	15047395
Reduced:	NO2C25H25 (1)
Stoich.:	AB2C25D25 (1)
Weight, g/mol:	201.115364
ΔH_f, kcal/mol:	-10.68
Dipole, Da:	1.59
IP(EA), eV:	-9.31(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-5-methyl-1H-2-benzazepine

Drug info:

PubChemData

Smile

CCOC1=NC(C2=CC=CC=C2C1(CC3=CC=CC=C3)CO)C4=CC=CC=C4

DOS

IR

Vibrations