Geometry & MOs

Info

ID:	346078
PubChem CID:	127270566
Reduced:	N3O4C20H29 (1)
Stoich.:	A3B4C20D29 (1)
Weight, g/mol:	397.268905
ΔH_f, kcal/mol:	-160.52
Dipole, Da:	2.22
IP(EA), eV:	-8.25(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C

DOS

IR

Vibrations