Geometry & MOs

Info

ID:	373969
PubChem CID:	131321828
Reduced:	NOC14H23 (1)
Stoich.:	ABC14D23 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-60.83
Dipole, Da:	2.22
IP(EA), eV:	-8.53(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-aminocyclohexyl)methyl]-1,3-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1C)C)[C@](C)(CO)N)C)C

DOS

IR

Vibrations