Geometry & MOs

Info

ID:	254657
PubChem CID:	103126794
Reduced:	N4C17H28 (1)
Stoich.:	A4B17C28 (1)
Weight, g/mol:	290.149124
ΔH_f, kcal/mol:	26.45
Dipole, Da:	0.99
IP(EA), eV:	-9.23(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(3-methylimidazol-4-yl)methyl]-5-pyrrolidin-2-yltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCC(C1=C2C=NC=CN2N=C1)N

DOS

IR

Vibrations