Geometry & MOs

Info

ID:	368700
PubChem CID:	127329886
Reduced:	N3O4C21H31 (1)
Stoich.:	A3B4C21D31 (1)
Weight, g/mol:	377.231456
ΔH_f, kcal/mol:	-156.21
Dipole, Da:	4.02
IP(EA), eV:	-8.24(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-4-(2-methoxyethyl)-3-methylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1CN(CCN1CCOC)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4

DOS

IR

Vibrations