Geometry & MOs

Info

ID:	346952
PubChem CID:	127271456
Reduced:	O2N3C21H31 (1)
Stoich.:	A2B3C21D31 (1)
Weight, g/mol:	360.252526
ΔH_f, kcal/mol:	-60.06
Dipole, Da:	4.21
IP(EA), eV:	-8.63(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[(1-morpholin-4-ylcyclohexyl)methyl]-1-(2-pyridin-4-ylethyl)urea

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)NC2(CC2)C3=CC=CC=C3)N4CCOCC4

DOS

IR

Vibrations