Geometry & MOs

Info

ID:	403867
PubChem CID:	135062224
Reduced:	SN2O3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-57.44
Dipole, Da:	5.58
IP(EA), eV:	-9.16(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N-[3-(1-oxoheptan-2-yl)pyridin-2-yl]propanamide

Drug info:

PubChemData

Smile

CCCCC1=C(N=C(O1)C2=CC=CC=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

DOS

IR

Vibrations