Geometry & MOs

Info

ID:	155169
PubChem CID:	56320908
Reduced:	O3N5H21C23 (1)
Stoich.:	A3B5C21D23 (1)
Weight, g/mol:	431.232125
ΔH_f, kcal/mol:	1.48
Dipole, Da:	7.2
IP(EA), eV:	-8.23(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-pyridin-4-ylethyl)piperidin-4-yl]-3-[3-(pyridin-2-ylmethoxy)phenyl]urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C=CC(=N2)CCNC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CO4

DOS

IR

Vibrations