Geometry & MOs

Info

ID:	146321
PubChem CID:	53669912
Reduced:	N3O5C24H33 (1)
Stoich.:	A3B5C24D33 (1)
Weight, g/mol:	300.16602
ΔH_f, kcal/mol:	-113.21
Dipole, Da:	1.82
IP(EA), eV:	-8.61(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methyl-3-[4-(3-methylbutylsulfanyl)phenyl]prop-2-enyl]imidazole

Drug info:

PubChemData

Smile

CC(C)N(C(C)C)C(=O)C1=CC(=C(C=C1)OCCCOC2=CC3C(C=C2)C(=NO3)N)OC

DOS

IR

Vibrations