Geometry & MOs

Info

ID:	58620
PubChem CID:	24712310
Reduced:	FON3C19H24 (1)
Stoich.:	ABC3D19E24 (1)
Weight, g/mol:	328.226312
ΔH_f, kcal/mol:	-32.98
Dipole, Da:	7.51
IP(EA), eV:	-9.21(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-benzylimidazol-2-yl)methyl]-1-(2-methylpropyl)-3-propan-2-ylurea

Drug info:

PubChemData

Smile

CC(C)C(=O)N(CC1CC1)CC2=NC=CN2CC3=CC=CC=C3F

DOS

IR

Vibrations