Geometry & MOs

Info

ID:	353991
PubChem CID:	127285648
Reduced:	O3N4C20H36 (1)
Stoich.:	A3B4C20D36 (1)
Weight, g/mol:	395.12084
ΔH_f, kcal/mol:	-184.24
Dipole, Da:	2.29
IP(EA), eV:	-9.46(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-bromophenyl)-cyclobutylmethyl]-3-[(4-methylmorpholin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CCC(CC)C(=O)N1CCC(CC1)NC(=O)NCC2CCN(CC2)C(=O)C

DOS

IR

Vibrations