Geometry & MOs

Info

ID:	353447
PubChem CID:	127285006
Reduced:	N3O3C19H33 (1)
Stoich.:	A3B3C19D33 (1)
Weight, g/mol:	334.236876
ΔH_f, kcal/mol:	-174.98
Dipole, Da:	6.66
IP(EA), eV:	-8.55(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1(CCCCC1)C(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations