Geometry & MOs

Info

ID:	285947
PubChem CID:	104140239
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	282.173213
ΔH_f, kcal/mol:	-59.06
Dipole, Da:	2.56
IP(EA), eV:	-8.42(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-ethyl-6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyridin-4-yl]methanol

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)CO)N2CCCC(C2C)C

DOS

IR

Vibrations