Geometry & MOs

Info

ID:	58626
PubChem CID:	24712322
Reduced:	ClON3C17H22 (1)
Stoich.:	ABC3D17E22 (1)
Weight, g/mol:	346.156039
ΔH_f, kcal/mol:	-24.69
Dipole, Da:	4.2
IP(EA), eV:	-9.17(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-[(2-chlorophenyl)methyl]imidazol-2-yl]methyl]-3-propan-2-yl-1-prop-2-enylurea

Drug info:

PubChemData

Smile

CCN(CC1=NC=CN1CC2=CC(=CC=C2)Cl)C(=O)C(C)C

DOS

IR

Vibrations