Geometry & MOs

Info

ID:	139779
PubChem CID:	52594321
Reduced:	N2O4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	360.08373
ΔH_f, kcal/mol:	-100.43
Dipole, Da:	2.76
IP(EA), eV:	-8.61(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-(4-bromo-2-methylphenyl)-1-propylurea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)NC[C@@H](C3=CC=C(C=C3)OC)O

DOS

IR

Vibrations