Geometry & MOs

Info

ID:	290236
PubChem CID:	104421309
Reduced:	O2N5C12H21 (1)
Stoich.:	A2B5C12D21 (1)
Weight, g/mol:	273.151098
ΔH_f, kcal/mol:	-70.93
Dipole, Da:	1.61
IP(EA), eV:	-9.2(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-methylpropylamino)-3-oxopropyl]thiomorpholine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)CCNC(=O)C(C1=CN(N=C1)C)N

DOS

IR

Vibrations