Geometry & MOs

Info

ID:	156213
PubChem CID:	56369581
Reduced:	O2N5C26H35 (1)
Stoich.:	A2B5C26D35 (1)
Weight, g/mol:	389.173942
ΔH_f, kcal/mol:	-56.81
Dipole, Da:	5.92
IP(EA), eV:	-8.47(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[1-(3-nitrophenyl)ethyl]-1-[(2-phenylphenyl)methyl]urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C(=O)NCC3=CN=C(C=C3)N4CCCCCC4

DOS

IR

Vibrations