Geometry & MOs

Info

ID:	253898
PubChem CID:	103121394
Reduced:	O2N6C13H18 (1)
Stoich.:	A2B6C13D18 (1)
Weight, g/mol:	253.153875
ΔH_f, kcal/mol:	20.12
Dipole, Da:	2.84
IP(EA), eV:	-9.19(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3Z)-3-amino-3-hydroxyiminopropyl]-1-methyl-N-propan-2-ylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(CC/C(=N/O)/N)C(=O)C1=C2C=NC=CN2N=C1

DOS

IR

Vibrations