Geometry & MOs

Info

ID:	212461
PubChem CID:	81060594
Reduced:	N3O3C13H15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	265.157898
ΔH_f, kcal/mol:	-55.71
Dipole, Da:	5.6
IP(EA), eV:	-9.72(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(2-propan-2-ylanilino)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=O)N)N(CC#C)CC(=O)O

DOS

IR

Vibrations