Geometry & MOs

Info

ID:	370014
PubChem CID:	127337226
Reduced:	O2N3C21H35 (1)
Stoich.:	A2B3C21D35 (1)
Weight, g/mol:	357.252861
ΔH_f, kcal/mol:	-130.98
Dipole, Da:	3.81
IP(EA), eV:	-8.95(1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]urea

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)NC23CC4CC(C2)CC(C4)C3)CC5CCOC5

DOS

IR

Vibrations