Geometry & MOs

Info

ID:	351444
PubChem CID:	127280332
Reduced:	N3O3C17H27 (1)
Stoich.:	A3B3C17D27 (1)
Weight, g/mol:	377.217538
ΔH_f, kcal/mol:	-144.16
Dipole, Da:	4.18
IP(EA), eV:	-8.83(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-[4-[4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carbonyl]triazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)CN2C(=O)C3CCCCC3C2=O

DOS

IR

Vibrations