Geometry & MOs

Info

ID:	343367
PubChem CID:	127266540
Reduced:	SN2O2C18H26 (1)
Stoich.:	AB2C2D18E26 (1)
Weight, g/mol:	254.153147
ΔH_f, kcal/mol:	-51.22
Dipole, Da:	4.51
IP(EA), eV:	-9.08(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-propan-2-yl-5-(2-pyrimidin-4-ylethenyl)pyridin-2-amine

Drug info:

PubChemData

Smile

C1CN(CCC1N2CCS(=O)(=O)CC2)CC=CC3=CC=CC=C3

DOS

IR

Vibrations