Geometry & MOs

Info

ID:	252813
PubChem CID:	103114305
Reduced:	O2N4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	30.32
Dipole, Da:	7.52
IP(EA), eV:	-9.21(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-methyl-3-nitrophenyl)methyl]-5-pyrrolidin-3-ylimidazole

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])CN2C=NC=C2C(C)(C)NC

DOS

IR

Vibrations