Geometry & MOs

Info

ID:	343221
PubChem CID:	127266394
Reduced:	ON2C9H14 (2)
Stoich.:	AB2C9D14 (2)
Weight, g/mol:	348.179755
ΔH_f, kcal/mol:	-65.43
Dipole, Da:	7.95
IP(EA), eV:	-9.04(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-[2-(furan-2-yl)ethylamino]-1-oxo-3-(1H-pyrazol-5-yl)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C1=NC=CN1CC(=O)N2CCCC(C2)C(=O)NCC3CC3

DOS

IR

Vibrations