Geometry & MOs

Info

ID:	14560
PubChem CID:	414755
Reduced:	ON4C13H15 (2)
Stoich.:	AB4C13D15 (2)
Weight, g/mol:	486.249172
ΔH_f, kcal/mol:	21.31
Dipole, Da:	5.01
IP(EA), eV:	-8.83(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(N,N'-dimethylcarbamimidoyl)phenyl]-3-[3-[[4-(N,N'-dimethylcarbamimidoyl)phenyl]carbamoylamino]phenyl]urea

Drug info:

PubChemData

Smile

CNC(=NC)C1=CC=C(C=C1)NC(=O)NC2=CC(=CC=C2)NC(=O)NC3=CC=C(C=C3)C(=NC)NC

DOS

IR

Vibrations