Geometry & MOs

Info

ID:	290053
PubChem CID:	104404237
Reduced:	O2N5C14H25 (1)
Stoich.:	A2B5C14D25 (1)
Weight, g/mol:	293.185175
ΔH_f, kcal/mol:	-76.15
Dipole, Da:	5.67
IP(EA), eV:	-8.95(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)acetamide

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1NC(C)C(=O)NCCOC)NCC

DOS

IR

Vibrations