Geometry & MOs

Info

ID:	326300
PubChem CID:	126687297
Reduced:	N2C7H18 (1)
Stoich.:	A2B7C18 (1)
Weight, g/mol:	235.123324
ΔH_f, kcal/mol:	-24.28
Dipole, Da:	2.28
IP(EA), eV:	-9.04(2.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-ethenyl-2-(methylamino)-2,3-dihydro-1H-pyrrol-4-yl]-5-fluoropyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC[C@H](CCNC)N

DOS

IR

Vibrations