Geometry & MOs

Info

ID:	218134
PubChem CID:	85088924
Reduced:	N4O5C22H32 (1)
Stoich.:	A4B5C22D32 (1)
Weight, g/mol:	431.115877
ΔH_f, kcal/mol:	-191.36
Dipole, Da:	4.08
IP(EA), eV:	-8.67(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dichlorophenyl)-2-[4-[3-(dimethylamino)propylamino]-6-methylpyrimidin-2-yl]guanidine;hydrochloride

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NO)NC(=O)OC(C)(C)C

DOS

IR

Vibrations