Geometry & MOs

Info

ID:	349576
PubChem CID:	127275728
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	285.205242
ΔH_f, kcal/mol:	-126.21
Dipole, Da:	4.07
IP(EA), eV:	-8.71(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2-morpholin-4-ylpropyl)-1,4-oxazepane-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NCC(C2=CC=CC(=C2)C)N3CCOCC3

DOS

IR

Vibrations