Geometry & MOs

Info

ID:	290514
PubChem CID:	104643452
Reduced:	N3O3C11H23 (1)
Stoich.:	A3B3C11D23 (1)
Weight, g/mol:	217.142641
ΔH_f, kcal/mol:	-150.34
Dipole, Da:	3.17
IP(EA), eV:	-9.28(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(3-amino-2-hydroxypropyl)pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1COCCN1CC(CN)O

DOS

IR

Vibrations