Geometry & MOs

Info

ID:	362252
PubChem CID:	127307265
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	375.263425
ΔH_f, kcal/mol:	-124.81
Dipole, Da:	3.87
IP(EA), eV:	-8.93(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1CN(CC(O1)C)C(=O)NCC2=CC=C(C=C2)CN3CCOCC3

DOS

IR

Vibrations