Geometry & MOs

Info

ID:	362290
PubChem CID:	127307312
Reduced:	O2N5C19H31 (1)
Stoich.:	A2B5C19D31 (1)
Weight, g/mol:	375.263425
ΔH_f, kcal/mol:	-73.07
Dipole, Da:	3.06
IP(EA), eV:	-8.41(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,4-dimethylpiperazin-2-yl)methyl]-3-[[3-(morpholin-4-ylmethyl)phenyl]methyl]urea

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NCC2=C(N=CC=C2)OC3CCCC3)C

DOS

IR

Vibrations