Geometry & MOs

Info

ID:	392410
PubChem CID:	135015567
Reduced:	NSO4H15C19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	321.078327
ΔH_f, kcal/mol:	-103.03
Dipole, Da:	11.9
IP(EA), eV:	-8.69(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[methyl(methylsulfonyl)amino]-4-phenylpyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)S(=O)(=O)N3C(C2)CC4=C3C=CC5=C4C=CC(=O)O5

DOS

IR

Vibrations