Geometry & MOs

Info

ID:	266574
PubChem CID:	103572215
Reduced:	N3O4C25H27 (1)
Stoich.:	A3B4C25D27 (1)
Weight, g/mol:	252.195011
ΔH_f, kcal/mol:	-95.85
Dipole, Da:	5.9
IP(EA), eV:	-9.0(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-morpholin-2-yl-N-[(1-propylpyrazol-4-yl)methyl]methanamine

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)C(C(=O)O)N(CC)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

DOS

IR

Vibrations