Geometry & MOs

Info

ID:	448748
PubChem CID:	135293256
Reduced:	FON7C15H18 (1)
Stoich.:	ABC7D15E18 (1)
Weight, g/mol:	314.149124
ΔH_f, kcal/mol:	-9.66
Dipole, Da:	7.95
IP(EA), eV:	-9.2(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-5-carbamimidoylpyridin-2-yl)-3-[(2-methoxyphenyl)methyl]urea

Drug info:

PubChemData

Smile

CCN=C(C1=CN=C(C=C1N)NC(=O)NCC2=C(C=CC=N2)F)N

DOS

IR

Vibrations