Geometry & MOs

Info

ID:	283631
PubChem CID:	103994543
Reduced:	N3O5C12H23 (1)
Stoich.:	A3B5C12D23 (1)
Weight, g/mol:	210.148061
ΔH_f, kcal/mol:	-248.92
Dipole, Da:	6.75
IP(EA), eV:	-9.86(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(1-methyltriazol-4-yl)methyl]pyrrolidin-3-yl]ethanol

Drug info:

PubChemData

Smile

CC(C)COCCCNC(=O)NC(CC(=O)N)C(=O)O

DOS

IR

Vibrations