Geometry & MOs

Info

ID:	343422
PubChem CID:	127266595
Reduced:	N3O4C16H19 (1)
Stoich.:	A3B4C16D19 (1)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-117.48
Dipole, Da:	5.68
IP(EA), eV:	-9.58(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(2-pyridin-4-ylpropanoylamino)methyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)C(C)NC(=O)C1=C2C=C(C=CN2N=C1)C=O

DOS

IR

Vibrations