Geometry & MOs

Info

ID:	306731
PubChem CID:	125236480
Reduced:	ON6C19H24 (1)
Stoich.:	AB6C19D24 (1)
Weight, g/mol:	275.138225
ΔH_f, kcal/mol:	38.45
Dipole, Da:	3.67
IP(EA), eV:	-9.23(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dimethyl-3-[(1R,5R)-3-(pyridazine-4-carbonyl)-3-azabicyclo[3.1.0]hexan-6-yl]urea

Drug info:

PubChemData

Smile

C1CC(C1)NC(=O)C2=NN=C3N2C[C@H]4CN(C[C@H]4C3)CC5=CC=CC=N5

DOS

IR

Vibrations