Geometry & MOs

Info

ID:	23056
PubChem CID:	601477
Reduced:	ClN6C14H17 (1)
Stoich.:	AB6C14D17 (1)
Weight, g/mol:	304.120322
ΔH_f, kcal/mol:	67.58
Dipole, Da:	4.27
IP(EA), eV:	-8.68(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-2-[4-(dimethylamino)-6-methylpyrimidin-2-yl]guanidine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N=C(N)NC2=CC=C(C=C2)Cl)N(C)C

DOS

IR

Vibrations