Geometry & MOs

Info

ID:	419845
PubChem CID:	135109345
Reduced:	N3O4C24H25 (1)
Stoich.:	A3B4C24D25 (1)
Weight, g/mol:	251.118238
ΔH_f, kcal/mol:	-75.43
Dipole, Da:	1.93
IP(EA), eV:	-8.84(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-4-methoxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)C(=O)N(CCO)CC4=CN=CN4C

DOS

IR

Vibrations