Geometry & MOs

Info

ID:	74017
PubChem CID:	48421358
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	269.148789
ΔH_f, kcal/mol:	-71.47
Dipole, Da:	3.72
IP(EA), eV:	-9.16(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[ethyl(2-hydroxypropyl)carbamoyl]amino]pyrazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CCN(CC(C)O)C(=O)NC1=CC=CC=N1

DOS

IR

Vibrations