Geometry & MOs

Info

ID:	349336
PubChem CID:	127275123
Reduced:	N2O4C21H32 (1)
Stoich.:	A2B4C21D32 (1)
Weight, g/mol:	320.173607
ΔH_f, kcal/mol:	-168.85
Dipole, Da:	3.98
IP(EA), eV:	-8.72(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(2-methyl-1,4-oxazepan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)CC(=O)NC(C2=CC3=C(C=C2)OCCCO3)C(C)C

DOS

IR

Vibrations