Geometry & MOs

Info

ID:	344069
PubChem CID:	127267245
Reduced:	O2N6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	32.61
Dipole, Da:	5.7
IP(EA), eV:	-8.53(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-cyclopropylpyridazin-3-yl)-3-(3-hydroxy-2,2-dimethyl-1-phenylpropyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=NN1C(C)C)NC(=O)NCC2=NOC(=N2)C3=CC=CC=C3

DOS

IR

Vibrations