Geometry & MOs

Info

ID:	284442
PubChem CID:	104046542
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	256.178693
ΔH_f, kcal/mol:	-27.98
Dipole, Da:	1.81
IP(EA), eV:	-9.52(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-[(4-ethylmorpholin-2-yl)methylamino]acetate

Drug info:

PubChemData

Smile

COC(=O)C(C1CC1)NCCN2C=CC=N2

DOS

IR

Vibrations