Geometry & MOs

Info

ID:	258584
PubChem CID:	103155435
Reduced:	N2O4C11H22 (1)
Stoich.:	A2B4C11D22 (1)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-200.43
Dipole, Da:	5.13
IP(EA), eV:	-9.66(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-[(2-pyrazol-1-ylphenyl)methyl]butanamide

Drug info:

PubChemData

Smile

CCC(C)N(CC(=O)O)C(=O)CC(CN)OC

DOS

IR

Vibrations