Geometry & MOs

Info

ID:	373771
PubChem CID:	131319884
Reduced:	NO3H10C12 (2)
Stoich.:	AB3C10D12 (2)
Weight, g/mol:	225.147727
ΔH_f, kcal/mol:	-172.31
Dipole, Da:	5.73
IP(EA), eV:	-8.91(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(1-methyl-4,5-dihydroimidazol-2-yl)piperidine-4-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)O)C4=NC(=CC=C4)C(=O)O

DOS

IR

Vibrations