Geometry & MOs

Info

ID:	291662
PubChem CID:	113456444
Reduced:	ClO2N5C9H10 (1)
Stoich.:	AB2C5D9E10 (1)
Weight, g/mol:	360.94789
ΔH_f, kcal/mol:	-9.97
Dipole, Da:	3.82
IP(EA), eV:	-9.11(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-6-methoxyphenyl)-5-iodopyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOC1=NNC(=N1)NC(=O)C2=CC(=CN2)Cl

DOS

IR

Vibrations