Geometry & MOs

Info

ID:	353459
PubChem CID:	127285018
Reduced:	N3O3C19H33 (1)
Stoich.:	A3B3C19D33 (1)
Weight, g/mol:	388.166604
ΔH_f, kcal/mol:	-166.07
Dipole, Da:	6.15
IP(EA), eV:	-9.12(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CCCC1C(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations