Geometry & MOs

Info

ID:	270700
PubChem CID:	103637739
Reduced:	SO2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	238.159375
ΔH_f, kcal/mol:	-55.85
Dipole, Da:	2.54
IP(EA), eV:	-8.82(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-(5-fluoro-6-methylpyrimidin-4-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=NNC(=O)C=C1)SC

DOS

IR

Vibrations