Geometry & MOs

Info

ID:	4334
PubChem CID:	11224
Reduced:	N2O5C21H28 (1)
Stoich.:	A2B5C21D28 (1)
Weight, g/mol:	388.199822
ΔH_f, kcal/mol:	-183.32
Dipole, Da:	9.53
IP(EA), eV:	-9.14(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butanedioic acid;N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)(C2=CC=CC=N2)OCCN(C)C.C(CC(=O)O)C(=O)O

DOS

IR

Vibrations