Geometry & MOs

Info

ID:	352036
PubChem CID:	127283104
Reduced:	O2N3C20H31 (1)
Stoich.:	A2B3C20D31 (1)
Weight, g/mol:	353.267842
ΔH_f, kcal/mol:	-99.26
Dipole, Da:	4.02
IP(EA), eV:	-8.88(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclohexyl)methyl]-3-[(1-morpholin-4-ylcyclohexyl)methyl]urea

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)NCC(C2=CC=CC=C2)N3CCCC3)O

DOS

IR

Vibrations