Geometry & MOs

Info

ID:	292015
PubChem CID:	114137359
Reduced:	SN2C14H26 (1)
Stoich.:	AB2C14D26 (1)
Weight, g/mol:	295.054611
ΔH_f, kcal/mol:	-28.61
Dipole, Da:	1.13
IP(EA), eV:	-8.87(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-[(5-ethylthiophen-2-yl)methylamino]-2-methylpyrimidine-5-carbaldehyde

Drug info:

PubChemData

Smile

CCC1(CSC(=N1)NCCCC2CCCC2)C

DOS

IR

Vibrations