Geometry & MOs

Info

ID:	202359
PubChem CID:	79663286
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	260.163711
ΔH_f, kcal/mol:	-38.37
Dipole, Da:	3.18
IP(EA), eV:	-8.8(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-amino-1-pyridin-2-ylbutyl)morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CCCN1CCOC(C1)C(=O)C2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations