Geometry & MOs

Info

ID:	168111
PubChem CID:	74924640
Reduced:	O3N6C19H26 (1)
Stoich.:	A3B6C19D26 (1)
Weight, g/mol:	372.190989
ΔH_f, kcal/mol:	-74.89
Dipole, Da:	8.24
IP(EA), eV:	-9.19(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-ethyl-6-oxo-1,3-diazinan-2-yl)-5-methylpyrazol-3-yl]-3-(4-methoxyphenyl)urea

Drug info:

PubChemData

Smile

CCC1CC(=O)NC(N1)N2C(=CC(=N2)C)NC(=O)NCC3=CC=C(C=C3)OC

DOS

IR

Vibrations