Geometry & MOs

Info

ID:	356866
PubChem CID:	127292470
Reduced:	O2N4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	313.247775
ΔH_f, kcal/mol:	-110.84
Dipole, Da:	3.97
IP(EA), eV:	-8.68(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylmorpholin-2-yl)methyl]-3-[1-(4-methylpiperazin-1-yl)propan-2-yl]urea

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NCC2CCCN(C2)C(C)C

DOS

IR

Vibrations